SCHEMBL3245785

SCHEMBL3245785

OC1/C=C/CCCCCCCCC1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1072263 1.00
SCHEMBL3245788 1.00 TSHR (0.32) TSHR
SCHEMBL13858711 1.00
SCHEMBL11613175 1.00 TSHR (0.32) TSHR
SCHEMBL25162318 1.00
SCHEMBL1072262 1.00
SCHEMBL25161927 1.00
SCHEMBL11613169 1.00 TSHR (0.32) TSHR
SCHEMBL1535243 1.00 TSHR (0.32) TSHR
SCHEMBL1535244 1.00 TSHR (0.32) TSHR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6204416-B1 HYDROGENATION USING COPPER CATALYST EMS-CHEMIE AG (CH) 2001-03-20 US claimed
US-4601851-A Cyclododec-2-enyl ethers in fragrance compositions HUELS AKTIENGESELLSCHAFT (DE) 1986-07-22 US claimed
EP-2772478-B1 Process for preparing ketones from epoxides EVONIK DEGUSSA GMBH (DE) 2016-04-13 EP disclosed
EP-2772478-B1 Process for preparing ketones from epoxides EVONIK DEGUSSA GMBH (DE) 2016-04-13 EP disclosed
US-9000223-B2 Process for preparing ketones from epoxides EVONIK INDUSTRIES AG (DE) 2015-04-07 US disclosed
US-9000223-B2 Process for preparing ketones from epoxides EVONIK INDUSTRIES AG (DE) 2015-04-07 US disclosed
US-9000223-B2 Process for preparing ketones from epoxides EVONIK INDUSTRIES AG (DE) 2015-04-07 US disclosed
US-20140249331-A1 PROCESS FOR PREPARING KETONES FROM EPOXIDES EVONIK INDUSTRIES AG (DE) 2014-09-04 US disclosed
US-20140249331-A1 PROCESS FOR PREPARING KETONES FROM EPOXIDES EVONIK INDUSTRIES AG (DE) 2014-09-04 US disclosed
US-20140249331-A1 PROCESS FOR PREPARING KETONES FROM EPOXIDES EVONIK INDUSTRIES AG (DE) 2014-09-04 US disclosed
EP-2772478-A1 Process for preparing ketones from epoxides Evonik Industries AG (DE) 2014-09-03 EP disclosed
US-6835686-B2 One pot process MILLENNIUM SPECIALTY CHEMICALS 2004-12-28 US disclosed
US-20030065230-A1 Catalyst system and process for rearrangement of epoxides to allylic alcohols PINOVA HOLDINGS, INC 2003-04-03 US disclosed
US-6204416-B1 HYDROGENATION USING COPPER CATALYST EMS-CHEMIE AG (CH) 2001-03-20 US disclosed
US-6204416-B1 HYDROGENATION USING COPPER CATALYST EMS-CHEMIE AG (CH) 2001-03-20 US disclosed
JP-2000319219-A CONVERSION OF CIS AND TRANS-CYCLODODECENE OXIDE TO CYCLODODECANONE EMS CHEMIE AG 2000-11-21 JP disclosed
US-4618724-A Perfluorocarbon polymer oxidation catalyst and preparation of carbonyl compound E. I. DU PONT DE NEMOURS AND COMPANY (US) 1986-10-21 US disclosed
US-4617153-A PERFLUOROCARBON POLYMER CONTAINING DIFLUOROMETHYLENE CHROMIUM SULFONYL PENDANT GROUPS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1986-10-14 US disclosed
US-4601851-A Cyclododec-2-enyl ethers in fragrance compositions HUELS AKTIENGESELLSCHAFT (DE) 1986-07-22 US disclosed
EP-0115582-A2 Use of cyclododecen-2-on as a perfuming agent and process for its preparation HÜLS AKTIENGESELLSCHAFT (DE) 1984-08-15 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140249331-A1 PROCESS FOR PREPARING KETONES FROM EPOXIDES EZH2, EPHX2, KDM4E TSHR 3333/4885
US-20030065230-A1 Catalyst system and process for rearrangement of epoxides to allylic alcohols ADH1A, ADH1C, ADH5 TSHR 3883/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.